SCHEMBL6817153

SCHEMBL6817153

NC(=O)CCCCCCCCCCCCCCCCCc1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ RARB P10826 5/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ RARA P10276 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ F13A1 P00488 3/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ FAAH O00519 2/20 0.38
▸ CES1 P23141 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7544521 0.81 RARB (0.42) MAPTRXFP1RARBMEN1ALDH1A1
SCHEMBL27388069 0.81 RARB (0.42) MAPTRXFP1RARBMEN1ALDH1A1
SCHEMBL9096952 0.79 RARB (0.41) MAPTRXFP1RARBMEN1ALDH1A1
SCHEMBL9978990 0.79 PLA2G2A (0.54) MEN1ALDH1A1KMT2AFAAH
SCHEMBL27561331 0.79 RARB (0.41) MAPTRXFP1RARBMEN1ALDH1A1
SCHEMBL3293447 0.79 RARB (0.62) MAPTRARBMEN1ALDH1A1RARA
SCHEMBL9979092 0.79 PLA2G2A (0.54) MEN1ALDH1A1KMT2AFAAH
SCHEMBL9979319 0.79 PLA2G2A (0.54) MEN1ALDH1A1KMT2AFAAH
SCHEMBL17060014 0.79 RARB (0.62) MAPTRARBMEN1ALDH1A1RARA
SCHEMBL27389337 0.79 RARB (0.41) MAPTRXFP1RARBMEN1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0797774-B1 MULTILAYER ANALYTICAL ELEMENT IMI INTERNAT MEDICAL INNOVATIO (CA) 2004-11-10 — — EP claimed
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